[Wien] x symmetry problem

[Gavin Abo]

If you search the mailing list archive, you should find that the error 
is commonly caused by rounding problems in the atomic positions:

http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg07944.html
http://www.mail-archive.com/wien%40zeus.theochem.tuwien.ac.at/msg06624.html

If you send the struct file, someone might be able to help you further.

On 4/4/2015 8:26 AM, ben amara imen wrote:
> Dear All,
>
>
> my struct file includes 2 atoms
>
> I do Initialization step on WIEN2k (2009) and it is ok
>
> I do again the same step on WIEN2k-11.1  , I have this problem :
>
> *_when runing x symmetry, this message is shown: 2 missing _*
>
> I understood  that the second atom is not found , even it is 
> eliminated from  struct.file
> what can I do ?
>
> Thank in advance
> Best
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